1-phenyl-2-(4-pyridin-4-ylpyridin-1-ium-1-yl)ethanone

Systemtic Name: 1-phenyl-2-(4-pyridin-4-ylpyridin-1-ium-1-yl)ethanone Openeye Name: 1-phenyl-2-[4-(4-pyridyl)pyridin-1-ium-1-yl]ethanone CAS Name: 1-phenyl-2-(4-pyridin-4-yl-1-pyridin-1-iumyl)ethanone IUPAC Name: 1-phenyl-2-(4-pyridin-4-ylpyridin-1-ium-1-yl)ethanone Traditional Name: 1-phenyl-2-[4-(4-pyridyl)pyridin-1-ium-1-yl]ethanone Formula: C18H15N2O+ MolecularWeight: 275.3245

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C[N+]2=CC=C(C=C2)C3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C[N+]2=CC=C(C=C2)C3=CC=NC=C3

InChI

InChI=1S/C18H15N2O/c21-18(17-4-2-1-3-5-17)14-20-12-8-16(9-13-20)15-6-10-19-11-7-15/h1-13H,14H2/q+1